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Information card for entry 7160132
Preview
| Coordinates | 7160132.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C100 H80 Cl4 N8 O8 |
|---|---|
| Calculated formula | C100 H84 Cl4 N8 O8 |
| Title of publication | Rh(III)-catalyzed [4 + 1] annulation of 1-arylindazolones with alkynyl cyclobutanols: access to indazolo[1,2-<i>a</i>]indazolones. |
| Authors of publication | Hu, Jiang; Liu, Jidan; Cui, Wenwen; Zheng, Liyao; Wang, Renjie; Liu, Zhao-Qing; Pu, Shouzhi |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2024 |
| Journal volume | 22 |
| Journal issue | 32 |
| Pages of publication | 6500 - 6505 |
| a | 8.944 ± 0.003 Å |
| b | 19.542 ± 0.007 Å |
| c | 12.592 ± 0.004 Å |
| α | 90° |
| β | 100.017 ± 0.007° |
| γ | 90° |
| Cell volume | 2167.3 ± 1.3 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296.15 K |
| Number of distinct elements | 5 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.2093 |
| Residual factor for significantly intense reflections | 0.15 |
| Weighted residual factors for significantly intense reflections | 0.359 |
| Weighted residual factors for all reflections included in the refinement | 0.3784 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.959 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 294393 (current) | 2024-09-05 | cif/ Adding structures of 7160132 via cif-deposit CGI script. |
7160132.cif |
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Users of the data should acknowledge the original authors of the
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